ASN 06581117
TL;DR: ASN 06581117 (CAS 606083-02-7) is a chemical compound with molecular formula C25H31N3O4S3 and molecular weight 533.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole
Also Known As: ASN 06581117, Piperidine,1-[[4-[[4- -1-piperidinyl]sulfonyl]phenyl]sulfonyl]-2,6-dimethyl-, 2-[1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole, PIPERIDINE, 1-[[4-[[4-(2-BENZOTHIAZOLYL)-1-PIPERIDINYL]SULFONYL]PHENYL]SULFONYL]-2,6-DIMETHYL-
| Molecular Formula | C25H31N3O4S3 |
|---|---|
| Molecular Weight | 533.15 g/mol |
| LogP | 4.8162 |
| Topological Polar Surface Area | 87.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 533.14764 |
| Heavy Atoms | 35 |
| Complexity | 1366.668 |
Chemical Identifiers
| CAS Number | 606083-02-7 |
|---|---|
| SMILES | CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C4=NC5=CC=CC=C5S4)C |
Product Overview
ASN 06581117 (CAS 606083-02-7), with molecular formula C25H31N3O4S3 and molecular weight 533.15 g/mol. IUPAC: 2-[1-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]sulfonylpiperidin-4-yl]-1,3-benzothiazole.
Chemical Property Profile of ASN 06581117
Property Insights of ASN 06581117
The XLogP value of 4.8162 indicates that ASN 06581117 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.65 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 06581117. Following Lipinski's Rule of Five, ASN 06581117 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ASN 06581117?
The CAS number of ASN 06581117 is 606083-02-7.
What is the molecular formula of ASN 06581117?
The molecular formula of ASN 06581117 is C25H31N3O4S3.
What is the molecular weight of ASN 06581117?
The molecular weight of ASN 06581117 is 533.15 g/mol.
Where can I buy ASN 06581117?
You can request a quote for ASN 06581117 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 06581117?
Yes, KEHONG BIO provides custom synthesis services for ASN 06581117 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.